{4-[6-(dimethylamino)-2-methylpyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
Chemical Structure Depiction of
{4-[6-(dimethylamino)-2-methylpyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
{4-[6-(dimethylamino)-2-methylpyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | D430-0038 |
| Compound Name: | {4-[6-(dimethylamino)-2-methylpyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone |
| Molecular Weight: | 370.41 |
| Molecular Formula: | C18 H22 N6 O3 |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 2.5731 |
| logD: | 1.6307 |
| logSw: | -2.6606 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.444 |
| InChI Key: | CBYQMDNDWQDOQG-UHFFFAOYSA-N |